REMARK  Name = BDB063528
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.130  -3.345  -0.151  0.00  0.00    +0.116 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        0.878  -2.190  -0.774  0.00  0.00    -0.033 A 
ATOM      3  C   LIG    1        2.068  -2.394  -1.478  0.00  0.00    +0.008 A 
ATOM      4  C   LIG    1        2.756  -1.311  -2.031  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1        2.274  -0.005  -1.891  0.00  0.00    +0.121 A 
ATOM      6  C   LIG    1        1.086   0.205  -1.196  0.00  0.00    +0.046 A 
ATOM      7  C   LIG    1        0.394  -0.880  -0.644  0.00  0.00    +0.008 A 
BRANCH   5   8
ATOM      8  O   LIG    1        3.062   0.955  -2.463  0.00  0.00    -0.487 OA
BRANCH   8   9
ATOM      9  C   LIG    1        2.648   2.321  -2.379  0.00  0.00    +0.264 C 
BRANCH   9  10
ATOM     10  C   LIG    1        2.964   2.965  -1.046  0.00  0.00    -0.009 A 
ATOM     11  C   LIG    1        2.148   3.999  -0.556  0.00  0.00    +0.027 A 
ATOM     12  C   LIG    1        2.447   4.613   0.662  0.00  0.00    +0.041 A 
ATOM     13 CL   LIG    1        1.438   5.879   1.252  0.00  0.00    -0.084 Cl
ATOM     14  C   LIG    1        3.558   4.212   1.403  0.00  0.00    +0.020 A 
ATOM     15  C   LIG    1        4.387   3.202   0.915  0.00  0.00    +0.002 A 
ATOM     16  C   LIG    1        4.095   2.586  -0.304  0.00  0.00    +0.007 A 
ENDBRANCH   9  10
ENDBRANCH   8   9
ENDBRANCH   5   8
ENDBRANCH   1   2
BRANCH   1  17
ATOM     17  N   LIG    1       -1.164  -3.539  -0.822  0.00  0.00    -0.304 NA
ATOM     18  H   LIG    1       -0.977  -3.868  -1.770  0.00  0.00    +0.123 HD
BRANCH  17  19
ATOM     19  C   LIG    1       -1.986  -4.551  -0.117  0.00  0.00    +0.177 C 
BRANCH  19  21
ATOM     20  O   LIG    1       -2.947  -4.646   2.114  0.00  0.00    -0.274 OA
ATOM     21  C   LIG    1       -2.628  -3.961   1.147  0.00  0.00    +0.227 C 
ATOM     22  N   LIG    1       -2.845  -2.605   1.063  0.00  0.00    -0.310 N 
ATOM     23  H   LIG    1       -2.389  -2.147   0.276  0.00  0.00    +0.149 HD
BRANCH  22  24
ATOM     24  C   LIG    1       -3.289  -1.827   2.189  0.00  0.00    +0.139 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -3.200  -0.354   1.884  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1       -4.179   0.270   1.098  0.00  0.00    +0.005 A 
ATOM     27  C   LIG    1       -4.077   1.627   0.784  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1       -2.990   2.371   1.243  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -2.003   1.759   2.017  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -2.107   0.403   2.336  0.00  0.00    +0.005 A 
ENDBRANCH  24  25
ENDBRANCH  22  24
ENDBRANCH  19  21
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 9